Vitas-M small molecule compound
2-amino-5-(3-methoxyphenyl)-1-methyl-3-[2-(3-nitrophenyl)-2-oxoethyl]-1H-imidazol-3-ium
Catalog ID
STK123532
SMILES COc1cccc(c1)c1c[n+](c(n1C)N)CC(=O)c1cccc(c1)[N+](=O)[O-]
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C19H19N4O4 MW 367.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N4O4/c1-21-17(13-5-4-8-16(10-13)27-2)11-22(19(21)20)12-18(24)14-6-3-7-15(9-14)23(25)26/h3-11,20H,12H2,1-2H3/p+1InChIKey
NSEKGGNNJGFQGH-UHFFFAOYSA-OSynonyms
2(2AMINO4(3METHOXYPHENYL)3METHYLIMIDAZOL1IUM1YL)1(3NITROPHENYL)ETHANONE
2AMINO5(3METHOXYPHENYL)1METHYL3(2(3NITROPHENYL)2OXOETHYL)1HIMIDAZOL3IUM
CN1C(=C(N+)(=C1N)CC(=O)C2=CC(=CC=C2)(N+)(=O)(O))C3=CC(=CC=C3)OC
COc1cccc(c1)c1c(n+)(c(n1C)N)CC(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC19H18N4O4c12117(1354816(1013)272)1122(19(21)20)1218(24)1463715(914)23(25)26h31120H12H212H3p+1
MFCD09267447
ZINC000334157576
ZINC04699367
ZINC4699367
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